(4-butyl-2-oxidanylidene-piperidin-1-yl)methyl-(3-octoxypropyl)-tetradecyl-azanium

Systemtic Name: (4-butyl-2-oxidanylidene-piperidin-1-yl)methyl-(3-octoxypropyl)-tetradecyl-azanium Openeye Name: (4-butyl-2-oxo-1-piperidyl)methyl-(3-octoxypropyl)-tetradecyl-ammonium CAS Name: (4-butyl-2-oxo-1-piperidinyl)methyl-(3-octoxypropyl)-tetradecylammonium IUPAC Name: (4-butyl-2-oxopiperidin-1-yl)methyl-(3-octoxypropyl)-tetradecylazanium Traditional Name: (4-butyl-2-keto-piperidino)methyl-myristyl-(3-octoxypropyl)ammonium Formula: C35H71N2O2+ MolecularWeight: 551.95044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[NH+](CCCOCCCCCCCC)CN1CCC(CC1=O)CCCC

Isomeric SMILES

CCCCCCCCCCCCCC[NH+](CCCOCCCCCCCC)CN1CCC(CC1=O)CCCC

InChI

InChI=1S/C35H70N2O2/c1-4-7-10-12-14-15-16-17-18-19-20-22-27-36(28-24-31-39-30-23-21-13-11-8-5-2)33-37-29-26-34(25-9-6-3)32-35(37)38/h34H,4-33H2,1-3H3/p+1